ID: 53719
SMILES:c1(O)c2c(cc(C(C)(CCCCCC)C)c1)OC(C)(C)C1CCC(C)(O)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.565
CB1 binding score: -15.525
InChIKey:JGWRTCPQNMHFJM-UHFFFAOYSA-N
ID: 53720
SMILES:CCCCCc1cc2c(c(O)c1)C1C(C(C)(CCC=C(C)C)O2)CCC(CO)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -17.015
InChIKey:CBZALZBZABBTIO-UHFFFAOYSA-N
ID: 53721
SMILES:CC1(C)Oc2cc(CCCCC)ccc21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 204.313
CB1 binding score: -17.245
InChIKey:TUBUPDOGTKRSBC-UHFFFAOYSA-N
ID: 53722
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1CC(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -20.541
InChIKey:XKRHRBJLCLXSGE-UHFFFAOYSA-N
ID: 53723
SMILES:C1C23C(C)CC(C1CC2)C(C)(C)Oc1cc(CCCCC)cc(O)c13
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -12.18
InChIKey:ZIKKSHJKHGOTAR-UHFFFAOYSA-N
ID: 53724
SMILES:c1(C)c(O)c2c(c(CCC(O)C(C)C)c1O)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -11.436
InChIKey:GDCIFYKWEAEQFF-UHFFFAOYSA-N
ID: 53725
SMILES:CC(=CCc1c(O)cc(CCc2cc(O)c(CC=C(C)CCC=C(C)C)c(O)c2)cc1C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 448.647
CB1 binding score: -16.217
InChIKey:JFRCBOTXAMIORD-UHFFFAOYSA-N
ID: 53726
SMILES:c1cc(-c2cc(O)ccc2O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 336.431
CB1 binding score: -14.695
InChIKey:RYWAFDOWOXXGSI-UHFFFAOYSA-N
ID: 53727
SMILES:c1(OC)c(C2C(C(C)C)CCC(C)=C2)c(O)cc(O)c1C1C(C(C)=C)CCC(CO)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.597
CB1 binding score: -15.929
InChIKey:HNPCOJSISLSWJQ-UHFFFAOYSA-N
ID: 53728
SMILES:c1(CCCCC)cc(O)c2c(c1)OC1(C2)C2C(CC=C1C)C(C)(C)OC2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -17.394
InChIKey:YPMPMVSRJUHGOY-UHFFFAOYSA-N
ID: 53729
SMILES:c1(CCC)cc2c(c(O)c1)C1C(CCC(CO)=C2)C(C)(C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -17.083
InChIKey:VYMORUDNAPYVPN-UHFFFAOYSA-N
ID: 53730
SMILES:c1(CCCCC)ccc2c(c1)OC(C1(C)CC(=O)C3=C(C)C(=O)C(O)=CC3(C)C1)=CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 420.549
CB1 binding score: -14.041
InChIKey:RABAHIRSUNNKEV-UHFFFAOYSA-N
ID: 53731
SMILES:O=C1c2c(cc(CCCCC)cc2O)OC(C)(C)C1=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.332
CB1 binding score: -18.334
InChIKey:HJLDQSFDBVFHQA-UHFFFAOYSA-N
ID: 53732
SMILES:O1c2cc(CCCCC)cc(O)c2C(C=CC(C)C)CC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -15.092
InChIKey:LCJKFEOOCCLVRA-UHFFFAOYSA-N
ID: 53733
SMILES:C1(C)CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -20.541
InChIKey:XKRHRBJLCLXSGE-UHFFFAOYSA-N
ID: 53734
SMILES:c1(CC=C(C)C)c(CCCCC)cc2c3c1OC(C)(C)C1CC=C(C)CC(C21)O3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.599
CB1 binding score: -15.637
InChIKey:GIAZYQZGYNYQQU-UHFFFAOYSA-N
ID: 53735
SMILES:C(C)(C)=CCCC(C)=CCCC(=CCc1c(O)cc(CCc2ccc(O)cc2)cc1O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.62
CB1 binding score: -19.427
InChIKey:VVBVATXKSUVSTB-UHFFFAOYSA-N
ID: 53736
SMILES:CC(C)=CCC1C(OC(=O)Cc2ccccc2)(C)CCC=C(C)CC1CCCCC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.642
CB1 binding score: -15.101
InChIKey:ONIOUQMQXIOALH-UHFFFAOYSA-N
ID: 53737
SMILES:O=C1C(C)=CC(c2ccc(CCCCC)cc2)C(C(C)=C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 296.454
CB1 binding score: -16.885
InChIKey:ZGTZBRKFZJGQFD-UHFFFAOYSA-N
ID: 53738
SMILES:C(CCc1cc2c(c(O)c1)C1CC(C=O)=CCC1C(C)(C)O2)C(O)(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.597
CB1 binding score: -14.652
InChIKey:PMGZCQDEDIUBRM-UHFFFAOYSA-N
ID: 53739
SMILES:c12cc(CCCCC)cc(O)c1C1(O2)C(C)(CCC(=O)O)C(C)CCC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -16.055
InChIKey:QHMRSKSRPDLTEU-UHFFFAOYSA-N