Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Ingredient: 1Target: 13Links: 18
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 69363
- Core Entity Id
- 132012
- Source Entity Count
- 1
- Preferred Name
- 7-Ethyl-10-hydroxycamptothecin
- Name En
- Pubchem Id
- 104842
- Smiles Canonical
- CCC1=C2CN3C(=CC4=C(C3=O)COC(=O)C4(CC)O)C2=NC5=C1C=C(C=C5)O
- Molecular Formula
- C22H20N2O5
- Molecular Weight
- 392.1400
- Inchikey
- FJHBVJOVLFPMQE-QFIPXVFZSA-N
- Inchi
- InChI=1S/C22H20N2O5/c1-3-12-13-7-11(25)5-6-17(13)23-19-14(12)9-24-18(19)8-16-15(20(24)26)10-29-21(27)22(16,28)4-2/h5-8,25,28H,3-4,9-10H2,1-2H3/t22-/m0/s1
- Isomeric Smiles
- Cas Id
- Ob Score
- Mol Logp
- 1.4000
- Num H Donors
- 2
- Num H Acceptors
- 6
- Num Rotatable Bonds
- 2
- Drug Likeness
- Polar Surface Area
- 100.0000
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
7-Ethyl-10-hydroxycamptothecin
Role
preferred
Source
ETCM_v2
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Etcm Ingredient
7-Ethyl-10-hydroxycamptothecin
Itcmdb Generated
ITX-INGREDIENT-51C483552D69
Attributes
Merged source attributes and domain-specific metadata.
Molecular Weight
392.140
Molecular Formula
C22H20N2O5
Fda Maximum Daily Dose (Fdamdd)
0.915
Quantitative Estimate Of Drug Likeness（Qed）
0.508