ID: 98764
SMILES:CCCCCc1cc2c(c(O)c1)C1C(C)(CC(C)(C)C3CCC(OC)(C)C4C31C4)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.642
CB1 binding score: -15.702
InChIKey:BSMTUZWWYZMTQV-UHFFFAOYSA-N
ID: 98765
SMILES:C1C2(C(C)C)Oc3c(c(O)cc(CCCCC)c3)C2CC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.979
InChIKey:RPIAMKIGKMZKPE-UHFFFAOYSA-N
ID: 98766
SMILES:CCCCCc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C(O)=O)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -18.707
InChIKey:OGXXAQFMAFTSRU-UHFFFAOYSA-N
ID: 98767
SMILES:c12cc(CCCCC)cc(OC)c1OC(C)(CCC=C(C)CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.615
CB1 binding score: -16.791
InChIKey:YGKFRXILTKCMFL-UHFFFAOYSA-N
ID: 98768
SMILES:Oc1c2c(cc(CCCCC)c1O)OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.71
InChIKey:QQTIDTRRWYIZRE-UHFFFAOYSA-N
ID: 98769
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 98770
SMILES:c1(CCCCCC)cc2c(c(O)c1)C1C(CCC(C)(O)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -17.427
InChIKey:UTXVBEHMQGNODO-UHFFFAOYSA-N
ID: 98771
SMILES:OCC1=CC2c3c(O)c(C(=O)O)c(CCCCC)cc3OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -17.888
InChIKey:PQLHCGPBCSGLBO-UHFFFAOYSA-N
ID: 98772
SMILES:C(CC=C(C)CC(c1c(O)cc(O)cc1CCCCC)=O)(=O)C(C)=C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -12.846
InChIKey:KCCZFDZDCNIYRC-UHFFFAOYSA-N
ID: 98773
SMILES:c12c(cc(CCCCC)cc1O)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: 98774
SMILES:C1C(C(C)C)CCC2(C)Oc3c(c(O)cc(CCCCC)c3)C=C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -16.515
InChIKey:XXZOUEXWVHBRFK-UHFFFAOYSA-N
ID: 98775
SMILES:C(CC)Cc1cc(O)c2c3c1C(=O)OC21OC(=O)C2(C(C)C1)CCC1(C)C(C)(C)C=C(O2)C31
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.547
CB1 binding score: -14.39
InChIKey:JFPIKQQWZJXGCU-UHFFFAOYSA-N
ID: 98776
SMILES:C1=C(C)CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 98777
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1=C2CC(C)CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -17.06
InChIKey:WQVFVTKXRBQFFH-UHFFFAOYSA-N
ID: 98778
SMILES:C(c1cc(O)c2c(c1C(OC)=O)OC(C)(C)C1CCC(C)=CC12)(C)CCCC(CO)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.585
CB1 binding score: -13.506
InChIKey:XFEFNGQAUSXGMT-UHFFFAOYSA-N
ID: 98779
SMILES:CC1(C)Oc2c(ccc(C)c2)C(=C)C1Cc1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.528
CB1 binding score: -12.451
InChIKey:QBAYXEYYTXACDR-UHFFFAOYSA-N
ID: 98780
SMILES:C(CCCCC)c1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.964
InChIKey:DMJVNNFBMZZLFB-UHFFFAOYSA-N
ID: 98781
SMILES:O=C1OC2C(C)(O)C3C1c1c(O)cc(CCCCC)cc1OC2(C)CC3
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -14.916
InChIKey:MVPMSPMLZXGLHO-UHFFFAOYSA-N
ID: 98782
SMILES:OCC(C)CCc1ccc2c(c1C(=O)O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -16.112
InChIKey:GXYOITCFWOKUGA-UHFFFAOYSA-N
ID: 98783
SMILES:C1C(C(=C)C)C(c2c(O)c(C(CCc3ccccc3)=O)c(O)c(CCC(C)C)c2O)C=C(C(CCC=C(CCC=C(C)C)C)C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 628.894
CB1 binding score: -16.131
InChIKey:XCRGHBCUDDPDQC-UHFFFAOYSA-N
ID: 98784
SMILES:C1(CCCC)Cc2c(c3c(cc2C)OC(C)(C)C3C=O)C=C1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -14.318
InChIKey:MUEVBUVUZDXUNR-UHFFFAOYSA-N