8f8fd619-72b0-43f8-89f5-3a35d2bc93f8
- Substance class
- chemical
- Definition type
- ALTERNATIVE
- Definition level
- COMPLETE
- Uuid
- 8f8fd619-72b0-43f8-89f5-3a35d2bc93f8
- Version
- 2
- Relationships
- Uuid
- 9656244b-4045-4344-938a-7a35dd089440
- Type
- SUB_ALTERNATE->SUBSTANCE
- Related substance
- Uuid
- 270ec941-486c-43a0-b7a2-a3c13351264f
- Refuuid
- b7aaf653-b25e-4c21-a094-b7b753bf8fd2
- Name
- SARMENTOSE
- UNII
- 41F6SJ1248
- Linking ID
- 41F6SJ1248
- Ref pname
- SARMENTOSE
- Substance class
- reference
- References
- Uuid
- 74da8e8b-b92e-bf5e-25e0-216198b9f6a1
- Citation
- STN
- Doc type
- STN (SCIFINDER)
- Public domain
- true
- Tags
- PUBLIC_DOMAIN_RELEASE
- Moieties
- Uuid
- 68c57fa2-f705-f2e7-ca82-2197a38149e2
- ID
- 68c57fa2-f705-f2e7-ca82-2197a38149e2
- Smiles
- C[C@@H]1[C@@H]([C@H](CC(O)O1)OC)O
- Formula
- C7H14O4
- Atropisomerism
- No
- Charge
- 0
- Count
- 1
- Stereochemistry
- EPIMERIC
- Defined stereo
- 3
- Ez centers
- 0
- Molecular weight
- 162.1839
- Optical activity
- UNSPECIFIED
- Stereo centers
- 4
- Molfile
Marvin 01132105272D 11 11 0 0 1 0 999 V2000 16.3479 -4.4826 0.0000 C 0 0 1 0 0 0 0 0 0 1 0 0 17.0624 -4.8950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3479 -3.6576 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.6335 -3.2450 0.0000 C 0 0 0 0 0 0 0 0 0 3 0 0 15.6335 -2.4200 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.9190 -3.6576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9190 -4.4826 0.0000 C 0 0 2 0 0 0 0 0 0 2 0 0 14.2046 -4.8951 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4901 -4.4826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6335 -4.8950 0.0000 C 0 0 1 0 0 0 0 0 0 2 0 0 15.6335 -5.7200 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 6 0 0 0 1 3 1 0 0 0 0 1 10 1 0 0 0 0 4 3 1 0 0 0 0 4 5 1 0 0 0 0 6 4 1 0 0 0 0 7 6 1 0 0 0 0 7 8 1 1 0 0 0 10 7 1 0 0 0 0 8 9 1 0 0 0 0 10 11 1 6 0 0 0 M END
- Count amount
- Type
- MOL RATIO
- Average
- 1
- Units
- MOL RATIO
- Uuid
- b2595d79-4010-491a-9eb6-25bd7693e9a3
- Structure
- ID
- 0bd842e2-4db1-d9dd-e3a8-6ba03a66fb27
- Smiles
- C[C@@H]1[C@@H]([C@H](CC(O)O1)OC)O
- Formula
- C7H14O4
- Atropisomerism
- No
- Charge
- 0
- Count
- 1
- Stereochemistry
- EPIMERIC
- Defined stereo
- 3
- Ez centers
- 0
- Molecular weight
- 162.1839
- Optical activity
- UNSPECIFIED
- Stereo centers
- 4
- Molfile
D-xylo-Hexopyranose, 2,6-dideoxy-3-O-methyl- Marvin 01132100522D 11 11 0 0 1 0 999 V2000 14.2046 -4.8951 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4901 -4.4826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9190 -4.4826 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 15.6335 -4.8950 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 15.6335 -5.7200 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.3479 -4.4826 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 17.0624 -4.8950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3479 -3.6576 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.6335 -3.2450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9190 -3.6576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6335 -2.4200 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 3 1 1 1 0 0 0 3 4 1 0 0 0 0 4 5 1 6 0 0 0 4 6 1 0 0 0 0 6 7 1 6 0 0 0 6 8 1 0 0 0 0 9 8 1 0 0 0 0 10 9 1 0 0 0 0 3 10 1 0 0 0 0 9 11 1 0 0 0 0 M END
- References
- 74da8e8b-b92e-bf5e-25e0-216198b9f6a1