Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 1Ingredient: 1Target: 17Links: 25
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 40337
- Core Entity Id
- 83348
- Source Entity Count
- 1
- Preferred Name
- (1s,2s,4r)-p-menth-1,2,8-triol 2-o-β-d-gluco-pyranoside
- Name En
- Pubchem Id
- 73112093
- Smiles Canonical
- CC(C)(O)C1CCC(C)(O)C(OC2OC(CO)C(O)C(O)C2O)C1
- Molecular Formula
- C16H30O8
- Molecular Weight
- 350.1900
- Inchikey
- SBRBBUQGGHWOFB-UHFFFAOYSA-N
- Inchi
- InChI=1S/C16H30O8/c1-15(2,21)8-4-5-16(3,22)10(6-8)24-14-13(20)12(19)11(18)9(7-17)23-14/h8-14,17-22H,4-7H2,1-3H3
- Isomeric Smiles
- Cas Id
- Ob Score
- Mol Logp
- -1.4000
- Num H Donors
- 6
- Num H Acceptors
- 8
- Num Rotatable Bonds
- 4
- Drug Likeness
- Polar Surface Area
- 140.0000
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
(1S,2S,4R)-p-Menth-1,2,8-triol 2-O-β-D-glucopyranoside
Role
preferred
Source
ETCM_v2
Preferred
Yes
Name
(1s,2s,4r)-p-menth-1,2,8-triol 2-o-β-d-gluco-pyranoside
Role
preferred
Source
TCMBank
Preferred
Yes
Aliases
Additional names normalized into the restored final schema.
(1S,2S,4R)-p-Menth-1,2,8-triol 2-O-β-D-glucopyranoside
Cross References
Trusted external identifiers retained for this final record.
Tcmbank
TCMBANKIN000683
Etcm Ingredient
(1S,2S,4R)-p-Menth-1,2,8-triol 2-O-β-D-glucopyranoside
Itcmdb Generated
ITX-INGREDIENT-ACF526E2D09A
Attributes
Merged source attributes and domain-specific metadata.
Smiles
CC1(CCC(CC1OC2C(C(C(C(O2)CO)O)O)O)C(C)(C)O)O
Molecular Weight
350.190
Molecular Formula
C16H30O8
Molecular Formula
C16H30O8
Fda Maximum Daily Dose (Fdamdd)
0.019
Quantitative Estimate Of Drug Likeness（Qed）
0.360