Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 1Ingredient: 1Links: 1
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 40554
- Core Entity Id
- 83565
- Source Entity Count
- 1
- Preferred Name
- Methyl Ganoderate C
- Name En
- Pubchem Id
- 101945500
- Smiles Canonical
- CC(CC(=O)CC(C)C(=O)OC)C1CC(=O)C2(C1(CC(=O)C3=C2C(CC4C3(CCC(=O)C4(C)C)C)O)C)C
- Molecular Formula
- C31H44O7
- Molecular Weight
- 528.7000
- Inchikey
- UVKCTPQUWRXRPX-AFQIALMBSA-N
- Inchi
- InChI=1S/C31H44O7/c1-16(11-18(32)12-17(2)27(37)38-8)19-13-24(36)31(7)26-20(33)14-22-28(3,4)23(35)9-10-29(22,5)25(26)21(34)15-30(19,31)6/h16-17,19-20,22,33H,9-15H2,1-8H3/t16-,17-,19-,20+,22+,29+,30-,31+/m1/s1
- Isomeric Smiles
- Cas Id
- Ob Score
- Mol Logp
- 2.2000
- Num H Donors
- 1
- Num H Acceptors
- 7
- Num Rotatable Bonds
- 7
- Drug Likeness
- Polar Surface Area
- 115.0000
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
Methyl Ganoderate C
Role
preferred
Source
SymMap_v2
Preferred
Yes
Name
Methyl ganoderate C
Role
preferred
Source
TCMBank
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Herb
HBIN035229
Sym Map
SMIT25383
Pub Chem
101945500
Tcmbank
TCMBANKIN001465
Itcmdb Generated
ITX-INGREDIENT-AD48A928E015
Attributes
Merged source attributes and domain-specific metadata.
Type
Other ingredients
Smiles
CC(CC(=O)CC(C)C(=O)OC)C1CC(=O)C2(C1(CC(=O)C3=C2C(CC4C3(CCC(=O)C4(C)C)C)O)C)C
Version
v2
Suppress
0
Molecular Weight
528.7 g/mol
Molecular Formula
C31H44O7