ANTIESTROGEN ,166664-90-0 _Chemical Cloud Database

ANTIESTROGEN

Basic Information
Product Name：	ANTIESTROGEN
CAS：	166664-90-0
English Synonyms：	H-CYS-ASN-VAL-VAL-PRO-LEU-TYR(PO3H2)-ASP-LEU-LEU-LEU-GLU-OH ; ANTIESTROGEN ; YP 537 FRAGMENT ; CYS-ASN-VAL-VAL-PRO-LEU-PTYR-ASP-LEU-LEU-LEU-GLU ; CNVVPLY(PO3H2)DLLLE ; CYS-ASN-VAL-VAL-PRO-LEU-TYR(PO3H2)-ASP-LEU-LEU-LEU-GLU
MDL Number.：	MFCD03787962
H bond acceptor：	35
H bond donor：	17
Smile：	CC(C)C[C@@H](C(=O)N[C@@H](Cc1ccc(cc1)OP(=O)(O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)O)NC(=O)[C@@H]2CCCN2C(=O)[C@H](C(C)C)NC(=O)[C@H](C(C)C)NC(=O)[C@H](CC(=O)N)NC(=O)[C@H](CS)N
InChi：	InChI=1S/C64H104N13O22PS/c1-30(2)22-40(54(84)67-39(64(94)95)19-20-49(79)80)69-55(85)41(23-31(3)4)70-56(86)42(24-32(5)6)71-59(89)46(28-50(81)82)73-58(88)44(26-36-15-17-37(18-16-36)99-100(96,97)98)72-57(87)43(25-33(7)8)74-61(91)47-14-13-21-77(47)63(93)52(35(11)12)76-62(92)51(34(9)10)75-60(90)45(27-48(66)78)68-53(83)38(65)29-101/h15-18,30-35,38-47,51-52,101H,13-14,19-29,65H2,1-12H3,(H2,66,78)(H,67,84)(H,68,83)(H,69,85)(H,70,86)(H,71,89)(H,72,87)(H,73,88)(H,74,91)(H,75,90)(H,76,92)(H,79,80)(H,81,82)(H,94,95)(H2,96,97,98)/t38-,39-,40-,41-,42-,43-,44-,45-,46-,47-,51-,52-/m0/s1
InChiKey：	InChIKey=NIBQNOUHTFWWCZ-UUPYPVMGSA-N

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