PROTAC CRABP-II Degrader-2 | CAS 1225383-38-9 | AnyMole

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HIT213841013

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HIT213841013

HIT ID:HIT213841013
Cas No:1225383-38-9
常用名:PROTAC CRABP-II Degrader-2
IUPAC:(2E,4E,6E,8E)-9-[(3Z)-3-{[({2-[2-(2-{[(2S)-2-[(2S,3R)-3-amino-2-hydroxy-4-phenylbutanamido]-4-methylpentanoyl]oxy}ethoxy)ethoxy]ethyl}carbamoyl)methoxy]imino}-2,6,6-trimethylcyclohex-1-en-1-yl]-3,7-dimethylnona-2,4,6,8-tetraenoic acid
IUPAC:(2E,4E,6E,8E)-9-[(3Z)-3-{[({2-[2-(2-{[(2S)-2-[(2S,3R)-3-amino-2-hydroxy-4-phenylbutanamido]-4-methylpentanoyl]oxy}ethoxy)ethoxy]ethyl}carbamoyl)methoxy]imino}-2,6,6-trimethylcyclohex-1-en-1-yl]-3,7-dimethylnona-2,4,6,8-tetraenoic acid
InChI key:LJDTZKKSXVIAPQ-ZODBEEQNSA-N

分子式:C44H64N4O10
分子量:809.014
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:CC(C)C[C@H](NC(=O)[C@@H](O)[C@H](N)Cc1ccccc1)C(=O)OCCOCCOCCNC(=O)CO\N=C1\CCC(C)(C)C(\C=C\C(\C)=C\C=C\C(\C)=C\C(O)=O)=C1C |c:56|
SMILES:CC(C)C[C@H](NC(=O)[C@@H](O)[C@H](N)Cc1ccccc1)C(=O)OCCOCCOCCNC(=O)CO\N=C1\CCC(C)(C)C(\C=C\C(\C)=C\C=C\C(\C)=C\C(O)=O)=C1C |c:56|

PROTAC CRABP-II Degrader-2 is a potent cIAp1-based degrader of cellular retinoic acid binding protein (CRABP-II).

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