ID: 119050
SMILES:CC1(C)Oc2cc(CCCCC)cc(OC)c2OC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 264.365
CB1 binding score: -16.917
InChIKey:GGPSDEGULUGZPD-UHFFFAOYSA-N
ID: 119051
SMILES:c1(OC)c(C2C=C(C)CCC2C(C)=C)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.302
InChIKey:IPGGELGANIXRSX-UHFFFAOYSA-N
ID: 119052
SMILES:c1(O)c2c(cc(C)c1)C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -19.176
InChIKey:SCKBYPQUVQGVFF-UHFFFAOYSA-N
ID: 119053
SMILES:c1(CC=C(CC2C(C(C)=C)CCC(C)=C2)C(=O)O)cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 490.64
CB1 binding score: -16.891
InChIKey:KHSKMXCXVUXSPK-UHFFFAOYSA-N
ID: 119054
SMILES:c1c(O)c(C2C=C(C)CCC2C(=C)C)c(O)cc1C(CC(C)C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -17.419
InChIKey:HYXJZSBKNKJZHQ-UHFFFAOYSA-N
ID: 119055
SMILES:C1C(C(C)=C)C(c2c(O)cc(O)cc2CCCCC)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.677
InChIKey:YWEZXUNAYVCODW-UHFFFAOYSA-N
ID: 119056
SMILES:CC(C)C(C)(CCC=C(C)CC1Oc2cc(CCCCC)cc(O)c2C1)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.565
CB1 binding score: -15.238
InChIKey:NBSGRRWEAZAPJB-UHFFFAOYSA-N
ID: 119057
SMILES:c1c(O)c(C2C=C(C)CCC2C(C)=C)c(OC)cc1CCO
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -16.787
InChIKey:TVZWEXQMPSOFRR-UHFFFAOYSA-N
ID: 119058
SMILES:O(O)C1(C)CCC=C(C)CCC2C(C(C)(C)Oc3cc(CCCCC)cc(O)c32)C1CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 484.721
CB1 binding score: -16.502
InChIKey:LQUDVHYZWOWEPH-UHFFFAOYSA-N
ID: 119059
SMILES:c1(C2C(C(=C)C)C(c3c(O)cc(CCCCC)cc3O)C=C(C)C2)c(O)c2c(C(C=C)(CCC=C(C)C)C)cc(=O)oc2cc1
Pathway: Shikimates and Phenylpropanoids;Terpenoids
Superclass: Meroterpenoids;Coumarins
Class: Cannabinoids;Simple coumarins
MW: 610.835
CB1 binding score: -13.737
InChIKey:ZSZGJFYUCFXWNJ-UHFFFAOYSA-N
ID: 119060
SMILES:C1(C(C)=C)CC(O)C(C)=CC1c1c(O)cc(CC=C(C)CCC=C(C)CCC=C(C)C)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.69
CB1 binding score: -15.302
InChIKey:RNICNVBDPDNSJG-UHFFFAOYSA-N
ID: 119061
SMILES:C1CC2(C)Oc3cc(CCCCC)cc(O)c3C(C2(C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -15.658
InChIKey:NYNFVNVLXKIYIW-UHFFFAOYSA-N
ID: 119062
SMILES:c12cc(O)ccc1OC(C)(C)C1CC=C(C)C(O)C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -17.057
InChIKey:OGOAPLJUFMNRCL-UHFFFAOYSA-N
ID: 119063
SMILES:C1(C)(O)CCCC(C)(C)C1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.473
CB1 binding score: -17.354
InChIKey:UNLFZSQAOQBPOQ-UHFFFAOYSA-N
ID: 119064
SMILES:C(C)CCCc1cc(O)c(C2CC(C)(O)CCC2C(C)(C)O)c(OC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.526
CB1 binding score: -16.62
InChIKey:IGTBCQKVZLMVBM-UHFFFAOYSA-N
ID: 119065
SMILES:C(C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1OC(C)=O)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -17.907
InChIKey:ZHSHEBZNPKWMSD-UHFFFAOYSA-N
ID: 119066
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)C1CCC(C)(O)C(O)C12)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 306.402
CB1 binding score: -16.429
InChIKey:WYPRBKHRIMRRNU-UHFFFAOYSA-N
ID: 119067
SMILES:C1(C)(CO)C(CCC(Oc2c(CC=C(C)C)c(CCCCC)cc(O)c2)C)=C(C)CCC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.684
CB1 binding score: -11.593
InChIKey:UQWATZAINKEYBH-UHFFFAOYSA-N
ID: 119068
SMILES:CC12Oc3c(c(O)c(C(=O)O)c(CCCCC)c3)C1C=C(C)CC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -15.803
InChIKey:MIFIUYXVSHFLHU-UHFFFAOYSA-N
ID: 119069
SMILES:c1(OC)cccc(O)c1C1C=C(C)CCC1C(C)=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.829
InChIKey:FPBTVEQKCBCFLI-UHFFFAOYSA-N
ID: 119070
SMILES:c1(O)cc(CCCCC)cc2c1C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N