Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 2Ingredient: 1Links: 2
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 62391
- Core Entity Id
- 109409
- Source Entity Count
- 1
- Preferred Name
- (6S,7E,9R)-Roseoside
- Name En
- Pubchem Id
- 9930064
- Smiles Canonical
- CC1=CC(=O)CC(C1(C=CC(C)OC2C(C(C(C(O2)CO)O)O)O)O)(C)C
- Molecular Formula
- C19H30O8
- Molecular Weight
- 386.4000
- Inchikey
- SWYRVCGNMNAFEK-MHXFFUGFSA-N
- Inchi
- InChI=1S/C19H30O8/c1-10-7-12(21)8-18(3,4)19(10,25)6-5-11(2)26-17-16(24)15(23)14(22)13(9-20)27-17/h5-7,11,13-17,20,22-25H,8-9H2,1-4H3/b6-5+/t11-,13-,14-,15+,16-,17-,19-/m1/s1
- Isomeric Smiles
- Cas Id
- Ob Score
- Mol Logp
- -1.0000
- Num H Donors
- 5
- Num H Acceptors
- 8
- Num Rotatable Bonds
- 5
- Drug Likeness
- Polar Surface Area
- 137.0000
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
(6S,7E,9R)-Roseoside
Role
Molecule_name
Source
SymMap_v2
Preferred
Yes
Name
(6S,7E,9R)-Roseoside
Role
preferred
Source
SymMap_v2
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Sym Map
SMIT19884
Itcmdb Generated
ITX-INGREDIENT-9D8D0CA3509C
Attributes
Merged source attributes and domain-specific metadata.
Type
Other ingredients
Version
v2
Suppress
0