Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 3Ingredient: 1Links: 3
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 71777
- Core Entity Id
- 134426
- Source Entity Count
- 1
- Preferred Name
- Eleutheroside
- Name En
- Pubchem Id
- 12305897
- Smiles Canonical
- COC1=CC(=CC(=C1OC2C(C(C(C(O2)CO)O)O)O)OC)C3C4COC(C4CO3)C5=CC(=C(C(=C5)OC)OC6C(C(C(C(O6)CO)O)O)O)OC
- Molecular Formula
- C34H46O18
- Molecular Weight
- 742.2700
- Inchikey
- FFDULTAFAQRACT-ZQBBDQPESA-N
- Inchi
- InChI=1S/C34H46O18/c1-43-17-5-13(6-18(44-2)31(17)51-33-27(41)25(39)23(37)21(9-35)49-33)29-15-11-48-30(16(15)12-47-29)14-7-19(45-3)32(20(8-14)46-4)52-34-28(42)26(40)24(38)22(10-36)50-34/h5-8,15-16,21-30,33-42H,9-12H2,1-4H3/t15-,16+,21-,22-,23-,24-,25+,26+,27-,28-,29?,30?,33+,34+/m1/s1
- Isomeric Smiles
- Cas Id
- Ob Score
- Mol Logp
- -1.4000
- Num H Donors
- 8
- Num H Acceptors
- 18
- Num Rotatable Bonds
- 12
- Drug Likeness
- Polar Surface Area
- 254.0000
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
Eleutheroside
Role
preferred
Source
ETCM_v2
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Etcm Ingredient
Eleutheroside
Itcmdb Generated
ITX-INGREDIENT-54B49588785D
Attributes
Merged source attributes and domain-specific metadata.
Molecular Weight
742.270
Molecular Formula
C34H46O18
Fda Maximum Daily Dose (Fdamdd)
0.071
Quantitative Estimate Of Drug Likeness（Qed）
0.119