ID: 45067
SMILES:O1C2(C)CC=CC3C(C)(C)Oc4cc(O)c(C(=O)C(CC)C)c(O)c4C1C32
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.461
CB1 binding score: -16.502
InChIKey:ZIABNHOKAWZMMX-UHFFFAOYSA-N
ID: 45068
SMILES:C12(C)C(C)(C(O)CCC1(C)C)Oc1c(c(O)cc(CCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -14.517
InChIKey:HTMHJWSJSSZCGE-UHFFFAOYSA-N
ID: 45069
SMILES:C1(=O)C(COC(C)=O)=CC2C(C1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.488
CB1 binding score: -16.89
InChIKey:HNOWFJWOPJQSPJ-UHFFFAOYSA-N
ID: 45070
SMILES:C(CCCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C(=O)OC)=CC21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17.943
InChIKey:CCMWHLPOQSRJEP-UHFFFAOYSA-N
ID: 45071
SMILES:C1C2(C)Oc3c(c(O)cc(CCCCC)c3)C(C=C(C)C)C2(C)C(O)(C)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -15.42
InChIKey:SGKAOITZTSWNME-UHFFFAOYSA-N
ID: 45072
SMILES:O(C)c1c2c(cc(CCCCC)c1)OC(C)(C)C1C2C=C(C(OC)=O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -17.557
InChIKey:BBGXJMKVNZJXJH-UHFFFAOYSA-N
ID: 45073
SMILES:C1C(C)=CCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 45074
SMILES:CC(C=CCC(C)C)=CCCC(C)=CCc1c(O)c(C(=O)O)c(CCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -14.935
InChIKey:IYWSQKMQTLHKBX-UHFFFAOYSA-N
ID: 45075
SMILES:C(O)C1=CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 45076
SMILES:CCCc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.805
InChIKey:CDBDULHNWQRYSY-UHFFFAOYSA-N
ID: 45077
SMILES:c12c(cc(OC)c(CCCCC)c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.334
InChIKey:YHJDVXSICIKMSR-UHFFFAOYSA-N
ID: 45078
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C1=C2C(O)C(C)=CC1)CC(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -13.587
InChIKey:SNIZOQOGAIUWLW-UHFFFAOYSA-N
ID: 45079
SMILES:CC1=CC2C(CC1)C(C)(C)Oc1c2c(O)ccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -19.281
InChIKey:KZTIITBECKQIPO-UHFFFAOYSA-N
ID: 45080
SMILES:C(CCCC)c1cc(O)c(CC=C(C)CCC=C(C)CCC=C(C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 384.604
CB1 binding score: -20.123
InChIKey:WYEFRBILENQYOH-UHFFFAOYSA-N
ID: 45081
SMILES:C12(C(OC(C)=O)C=C(C)CC1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -14.513
InChIKey:OFHGFGFHEDUQNU-UHFFFAOYSA-N
ID: 45082
SMILES:c1(OC)cc(CCCC)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.078
InChIKey:ODAAMGPRCVIPGM-UHFFFAOYSA-N
ID: 45083
SMILES:O1C(C)C2=C(CCC1)COc1cc(CCCCC)cc(O)c12
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -17.015
InChIKey:CYYJMVBFHGUKQC-UHFFFAOYSA-N
ID: 45084
SMILES:c1(O)c(CC=C(C)CCC=C(C)C)c(O)c2c(c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.571
CB1 binding score: -18.334
InChIKey:JOHPXVUMKMAGCY-UHFFFAOYSA-N
ID: 45085
SMILES:CC(=CCc1c(O)c(C)cc(OC(C)=O)c1)CCC1C(C)(C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -15.507
InChIKey:JXXVCYUXIWXCBT-UHFFFAOYSA-N
ID: 45086
SMILES:C(CCCC)c1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 45087
SMILES:c1(O)cc2c(cc1)OC(C)(C)C1CC=C(C)CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -19.07
InChIKey:LIEZPCZOEMYUIR-UHFFFAOYSA-N