ID: 91708
SMILES:C(O)C(C)c1cc(O)c(CC=C(C)CCC=C(C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -16.855
InChIKey:OCEVRNDZPIEMMM-UHFFFAOYSA-N
ID: 91709
SMILES:O=C(O)C(c1cc2c(c(O)c1)C1C=C(C)C(OC(=O)C)CC1C(C)(C)O2)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.46
CB1 binding score: -16.636
InChIKey:DCQJSZXJITWGMT-UHFFFAOYSA-N
ID: 91710
SMILES:C1(C)(C)C(C)=C(Cc2c(O)cc(CCCCC)c(C(=O)O)c2O)C(C(C=C(C)CCC=C(C)C)O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 512.731
CB1 binding score: -16.688
InChIKey:UASFYEJNXNUPIW-UHFFFAOYSA-N
ID: 91711
SMILES:C1CC(CCC=C(C)C)=CCc2c1cc(CCCCC)cc2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.497
CB1 binding score: -16.135
InChIKey:UGGQZZSBWHYHAJ-UHFFFAOYSA-N
ID: 91712
SMILES:O(c1c(C(=O)O)cc(O)c2c1OC(C)(C)C1CC=C(C)CC21)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.369
CB1 binding score: -14.38
InChIKey:JXIRLBGZXUVMEQ-UHFFFAOYSA-N
ID: 91713
SMILES:c1c2c(cc(C)c1)-c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 91714
SMILES:C(CCCC)Cc1cc2c(c(O)c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -16.357
InChIKey:QLJKRNAQULDIOJ-UHFFFAOYSA-N
ID: 91715
SMILES:C(Cc1cc(O)c(C2OC3C(CO)(O)CC3(CCC(C)C)O2)c(O)c1)CO
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.453
CB1 binding score: -16.449
InChIKey:ZZDYRQGKTZXLSE-UHFFFAOYSA-N
ID: 91716
SMILES:c12cc(CCCCC)cc(OC3C(O)C(O)C(O)C(CO)O3)c1OC(C)(C)C1C2C=C(CO)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 492.609
CB1 binding score: -14.605
InChIKey:PDHPHQSHJNFZAV-UHFFFAOYSA-N
ID: 91717
SMILES:C(CCC)Cc1cc(O)c(CC2C(O)(C)CC=C2C(C)=C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.929
InChIKey:GADODUXEXCCKMF-UHFFFAOYSA-N
ID: 91718
SMILES:Oc1c(C2C(C(=C)C)CCC(C)=C2)c(O)cc(CCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.532
InChIKey:REOZWEGFPHTFEI-UHFFFAOYSA-N
ID: 91719
SMILES:CC1CCC(C(C)=C)CC1COc1cc(CCCCC)cc(OC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.539
CB1 binding score: -14.574
InChIKey:MUNZYGGDNSDUMS-UHFFFAOYSA-N
ID: 91720
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 91721
SMILES:CC(C)C12Oc3c(c(O)c(CC=C(CCC=C(C)C)C)c(O)c3)C1CCC(C)=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.571
CB1 binding score: -14.166
InChIKey:CWJDQDNWQLVRHR-UHFFFAOYSA-N
ID: 91722
SMILES:C1C(C(C)C)C(c2c(O)cc(CCCCC)cc2O)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 91723
SMILES:C(C)(=CCCC1(C)Oc2cc(C)cc(O)c2C2C1CC=C(C)C2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Bisabolane sesquiterpenoids;Cannabinoids
MW: 326.48
CB1 binding score: -17.035
InChIKey:DBBSIKFPXDZOLG-UHFFFAOYSA-N
ID: 91724
SMILES:c1c(CC=C)cc2c(c1)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 268.4
CB1 binding score: -17.63
InChIKey:NOFAJVYJFXMQDU-UHFFFAOYSA-N
ID: 91725
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 91726
SMILES:C(C=C(C)C)Cc1cc2c(c(O)c1)C1C(C3C=C(C)CCC3C(C)(C)O1)C(C)(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.598
CB1 binding score: -15.035
InChIKey:OKWHLLMPZMSIHF-UHFFFAOYSA-N
ID: 91727
SMILES:c1(C=O)c(O)c(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.343
CB1 binding score: -18.114
InChIKey:RLIGGHCPEUOXBS-UHFFFAOYSA-N
ID: 91728
SMILES:CC1=CCC(C(C)=C)C(c2c(O)cc(CCc3ccccc3)cc2O)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.486
CB1 binding score: -15.941
InChIKey:UJXXIKUKWUWSQE-UHFFFAOYSA-N