ID: 77722
SMILES:C(CCc1c(O)cc(O)c2c1OC(C)(C)C1C2C(=C)CC1)C(C)=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -15.433
InChIKey:PYEBNYHCVNCALL-UHFFFAOYSA-N
ID: 77723
SMILES:C12C(C(C)(C)Oc3cc(CCC)cc(O)c31)CCC(C=CC=C(C)C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 352.518
CB1 binding score: -11.82
InChIKey:SCBUEQJDPQUINS-UHFFFAOYSA-N
ID: 77724
SMILES:C1C2Oc3c(c(O)cc(C)c3)C(CC(=C)C=C)C(CCC=C(C)C)(C)C2CC=C1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 406.61
CB1 binding score: -13.753
InChIKey:HPQISULYLQPWEE-UHFFFAOYSA-N
ID: 77725
SMILES:C(C1(O)CCC2c3c(cc(CCCCC)cc3O)OC(C=C(C)C)C21)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -13.39
InChIKey:FPFLPIIHHIWWOG-UHFFFAOYSA-N
ID: 77726
SMILES:CC(=C)C1CCC(C)=C(CC(C(=CCc2cc(OC)c(O)cc2C)C)O)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -16.221
InChIKey:FWHPYKOHIOPTDL-UHFFFAOYSA-N
ID: 77727
SMILES:C1(C(C)(C)O)=CC2(C)Oc3c(c(OC(=O)C)c(Cl)c(CCCC)c3O)C2CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.922
CB1 binding score: -13.268
InChIKey:YNIJUUIZWLCDQD-UHFFFAOYSA-N
ID: 77728
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.964
InChIKey:DMJVNNFBMZZLFB-UHFFFAOYSA-N
ID: 77729
SMILES:C(C)CC(=O)OCCCc1cc2c(c(O)c1)C1C(C(=C)C)CCC(C)(O2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -15.297
InChIKey:LPRHHCZGYLBOHQ-UHFFFAOYSA-N
ID: 77730
SMILES:c1(O)c(C(=O)CCCCC)cc2c(c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -16.613
InChIKey:VAHBSHSEGFCQGN-UHFFFAOYSA-N
ID: 77731
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)C1CCC(C(O)=O)=CC12)CC(O)(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.569
CB1 binding score: -16.374
InChIKey:LAAJNBWQTNEWJO-UHFFFAOYSA-N
ID: 77732
SMILES:C1(C(C)=C)CCC(C)=CC1c1c(O)c(=O)c(OC)c(C)c(OC)c1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -10.895
InChIKey:DVDDTYPJDHTTLX-UHFFFAOYSA-N
ID: 77733
SMILES:C1(C=CC=C(C)CC)(C)Oc2c(c(O)cc(CCCCC)c2)C(O)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -16.251
InChIKey:XFUOZPKXZJTMOG-UHFFFAOYSA-N
ID: 77734
SMILES:C(CC)CCc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C(=O)O)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -18.707
InChIKey:OGXXAQFMAFTSRU-UHFFFAOYSA-N
ID: 77735
SMILES:C(C)(C)=CCCC(c1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C(=O)OC)CC1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.543
CB1 binding score: -14.495
InChIKey:CGPFKPRFANSHRF-UHFFFAOYSA-N
ID: 77736
SMILES:CC1=CC(c2c(O)cc(CCCCC)cc2O)C(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 77737
SMILES:CC(C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1O)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -18.93
InChIKey:KYZZGUCXNYLZKE-UHFFFAOYSA-N
ID: 77738
SMILES:C1CC(C)=CC(c2c(OC)ccc(CCN(C)C)c2)C1C(=C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 313.485
CB1 binding score: -18.294
InChIKey:GJDVDGGMUGCJGX-UHFFFAOYSA-N
ID: 77739
SMILES:C1(C(=C)C)Cc2c(c(C(=O)CC(C)C)c(O)cc2C)OC1CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -14.586
InChIKey:ZGTJMNCKOAOCAV-UHFFFAOYSA-N
ID: 77740
SMILES:C(CC=C(CCC=C(C)C)C)C(=CCCC1(C)Oc2c(O)c(OC)cc(CCCCC)c2)C(C)(O)C=CC1=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 538.769
CB1 binding score: -15.927
InChIKey:UQXYUAIVKIVHAX-UHFFFAOYSA-N
ID: 77741
SMILES:C1=C(C(=O)OC)CCC2C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17.943
InChIKey:CCMWHLPOQSRJEP-UHFFFAOYSA-N
ID: 77742
SMILES:c1(CCCC(CCC=C(C)C)C)c2c(c(O)c(O)c1)C1C(=O)C(C)(C)C3CCC(C)(CC13)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 454.651
CB1 binding score: -15.466
InChIKey:PILOFUDNBYBPHM-UHFFFAOYSA-N