ID: 64450
SMILES:CC1(C)C2C(C3(c4c(cc(CCC)cc4O)OC3(C)C)O2)CCC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -14.542
InChIKey:MQEYCWPUOKDUNW-UHFFFAOYSA-N
ID: 64451
SMILES:c1(CCCCC)cc(O)c(C2C(C(C)=C)CC(O)C(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.385
InChIKey:YYLPAYRRVSQJRR-UHFFFAOYSA-N
ID: 64452
SMILES:OC(c1cc(CCC)c(C2C=C(C)CCC2C(C)C)c(O)c1)CC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -14.912
InChIKey:HCSPAIPBLQRWQU-UHFFFAOYSA-N
ID: 64453
SMILES:CC12CC=C(C)C(C)C1c1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -15.918
InChIKey:RBVMQPBAEAJQJO-UHFFFAOYSA-N
ID: 64454
SMILES:C1C2C(c3c(O)cc(CCCC)cc3OC2(C)C)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.843
InChIKey:QHCQSGYWGBDSIY-UHFFFAOYSA-N
ID: 64455
SMILES:C1CC(C)=CC(c2ccc(CCCCC)cc2)C(C(C)(C)O)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.513
CB1 binding score: -15.388
InChIKey:FIWQWEWJTGOLEC-UHFFFAOYSA-N
ID: 64456
SMILES:C(CCCC)c1cc2c(c(O)c1)C1C(C(=C)C)CCC(C)(O2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.198
InChIKey:NUXUDGMVYZUFNQ-UHFFFAOYSA-N
ID: 64457
SMILES:Oc1c(CCCCC)cc(O)c2c1OC(C)(C)C1CCC(CO)(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.51
CB1 binding score: -15.619
InChIKey:MWCHIQGAKPLYGP-UHFFFAOYSA-N
ID: 64458
SMILES:C1(O)C=C(C)CCCC(C)(C)Oc2cc(C(CCCCC)O)c(OC)c(OC)c21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 406.563
CB1 binding score: -12.722
InChIKey:AIMAJFGJFMRWMT-UHFFFAOYSA-N
ID: 64459
SMILES:C(C(CC)O)c1cc(O)c2c3c1OC1(C)CC3C(C(C)(C)O2)CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -18.707
InChIKey:RIEBUEZAVKVDOT-UHFFFAOYSA-N
ID: 64460
SMILES:CC(OC(=O)c1ccccc1)(C1CCC(C)=CC1c1c(OC)ccc(CCN(C)C)c1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 435.608
CB1 binding score: -15.981
InChIKey:FMGGPXCMJLEZLY-UHFFFAOYSA-N
ID: 64461
SMILES:C1CC2C(O1)C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.403
CB1 binding score: -15.929
InChIKey:MYPIEZINSQIGMX-UHFFFAOYSA-N
ID: 64462
SMILES:C1(OC(=O)C(CC)C)C(C)(CC=CC(C)(C)O)Oc2c(c(O)cc(CCCC)c2)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.573
CB1 binding score: -12.326
InChIKey:DTVMUWVFABPHRC-UHFFFAOYSA-N
ID: 64463
SMILES:CC12C3(CCC(C)C3CC1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -16.099
InChIKey:KVLYSMZWNCDEQH-UHFFFAOYSA-N
ID: 64464
SMILES:CCCCCc1cc(O)c2c(c1)OC(C)(CCC=C(CCC(=C(C)C)C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.615
CB1 binding score: -17.214
InChIKey:KYBUWEDIEPUBGV-UHFFFAOYSA-N
ID: 64465
SMILES:c12c(cc(O)cc1)OC(C)(C)C1C2C=C(CCC=C(C)C)C(=O)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -14.334
InChIKey:GPSIGHMXLUSLPO-UHFFFAOYSA-N
ID: 64466
SMILES:c1(O)c(C(=O)CC2(C(C)(CCC=C(C)C)C)Oc3c(c(O)cc(CCCCC)c3)C2O)ccc(O)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 496.644
CB1 binding score: -16.171
InChIKey:WIGXDJWNQHCNMD-UHFFFAOYSA-N
ID: 64467
SMILES:CC1(C)C2C(c3c(O)cc(CCCCC)cc3O2)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.329
InChIKey:NPGPTSSHYPTWND-UHFFFAOYSA-N
ID: 64468
SMILES:O=C(CC(C)C)Oc1cc(CCCCC)cc2c1C(=O)C(CC(C)(O)C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -13.749
InChIKey:QPTSAIIBUKXACR-UHFFFAOYSA-N
ID: 64469
SMILES:Oc1c2c(cc(CCCCC)c1)C=CC(C)(CCC=C(CCC=C(C)C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -18.633
InChIKey:JYKDJVQHEBZHTR-UHFFFAOYSA-N
ID: 64470
SMILES:C(CCCC)c1cc2c(c(O)c1)C1C=C(CO)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N