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
- 69166
- Core Entity Id
- 131815
- Source Entity Count
- 1
- Preferred Name
- 6-Carboxyfluorescein diacetate
- Name En
- Pubchem Id
- 151095
- Smiles Canonical
- CC(=O)OC1=CC2=C(C=C1)C3(C4=C(O2)C=C(C=C4)OC(=O)C)C5=C(C=CC(=C5)C(=O)O)C(=O)O3
- Molecular Formula
- C25H16O9
- Molecular Weight
- 460.0800
- Inchikey
- QMOGCCYGOPYYNT-UHFFFAOYSA-N
- Inchi
- InChI=1S/C25H16O9/c1-12(26)31-15-4-7-18-21(10-15)33-22-11-16(32-13(2)27)5-8-19(22)25(18)20-9-14(23(28)29)3-6-17(20)24(30)34-25/h3-11H,1-2H3,(H,28,29)
- Isomeric Smiles
- Cas Id
- Ob Score
- Mol Logp
- 3.2000
- Num H Donors
- 1
- Num H Acceptors
- 9
- Num Rotatable Bonds
- 5
- Drug Likeness
- Polar Surface Area
- 125.0000
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
6-Carboxyfluorescein diacetate
Role
preferred
Source
ETCM_v2
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Etcm Ingredient
6-Carboxyfluorescein diacetate
Itcmdb Generated
ITX-INGREDIENT-60DC8FBA2764
Attributes
Merged source attributes and domain-specific metadata.
Molecular Weight
460.080
Molecular Formula
C25H16O9
Fda Maximum Daily Dose (Fdamdd)
0.991
Quantitative Estimate Of Drug Likeness（Qed）
0.459