Ac-eevvp-nv-(co)-gdqdys-am

Structural Information

Molecular Formula

C₅₆H₈₄N₁₄O₂₁

SMILES

CCC[C@@H](C(=O)C(=O)NCC(=O)N[C@H](CCC(=O)N)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)N[C@@H](CO)C(=O)N)NC(=O)C2CCCN2C(=O)[C@H](C(C)C)NC(=O)[C@H](C(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)C

InChI

InChI=1S/C56H84N14O21/c1-7-9-31(63-53(88)38-10-8-21-70(38)56(91)45(27(4)5)69-54(89)44(26(2)3)68-50(85)34(17-20-43(79)80)64-48(83)32(61-28(6)72)16-19-42(77)78)46(81)55(90)60-24-41(76)62-33(15-18-39(57)74)49(84)66-36(23-40(58)75)52(87)65-35(22-29-11-13-30(73)14-12-29)51(86)67-37(25-71)47(59)82/h11-14,26-27,31-38,44-45,71,73H,7-10,15-25H2,1-6H3,(H2,57,74)(H2,58,75)(H2,59,82)(H,60,90)(H,61,72)(H,62,76)(H,63,88)(H,64,83)(H,65,87)(H,66,84)(H,67,86)(H,68,85)(H,69,89)(H,77,78)(H,79,80)/t31-,32-,33+,34-,35-,36-,37-,38?,44-,45-/m0/s1

InChIKey

HLWLNZRLPISUID-RVXAWHIQSA-N

Compound name

(4S)-4-acetamido-5-[[(2S)-1-[[(2S)-1-[[(2S)-1-[2-[[(3S)-1-[[2-[[(2R)-5-amino-1-[[(2S)-4-amino-1-[[(2S)-1-[[(2S)-1-amino-3-hydroxy-1-oxopropan-2-yl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]amino]-1,4-dioxobutan-2-yl]amino]-1,5-dioxopentan-2-yl]amino]-2-oxoethyl]amino]-1,2-dioxohexan-3-yl]carbamoyl]pyrrolidin-1-yl]-3-methyl-1-oxobutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-4-carboxy-1-oxobutan-2-yl]amino]-5-oxopentanoic acid

Related CIDs

• CID 504384
• CID 504385