ID: 125812
SMILES:c12c(O)cc(CCCC(=O)O)cc1C1C=C(C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -15.929
InChIKey:JRLNILOOPFIARP-UHFFFAOYSA-N
ID: 125813
SMILES:C(=C)CCCc1cc2c(c(O)c1)C1C(C(C)C)(O2)OC(C)(C=C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -13.475
InChIKey:OVZLVJPKZKYOMX-UHFFFAOYSA-N
ID: 125814
SMILES:c1(OC)c(O)c2c(cc1CCCCC)OC(C)(C)C1C2CC(=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -14.099
InChIKey:HBZWSHFNTZNRQG-UHFFFAOYSA-N
ID: 125815
SMILES:C1(C)(O)CCC2C(C)(C)Oc3c(c(O)cc(CCC=CC)c3)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.666
InChIKey:VQHSSDYOIFHIPB-UHFFFAOYSA-N
ID: 125816
SMILES:C(C1(O)CC2CC3C(C)(CC1)Oc1cc(CCCCC)cc(O)c1C23C(=O)c1c(O)c2c(cc1C)OC(C)(C)C=C2)=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 600.796
CB1 binding score: -13.534
InChIKey:QLKVUIDGVCLXJC-UHFFFAOYSA-N
ID: 125817
SMILES:Oc1c2c(cc3c1OC(C)(C)C(OC(C)=O)C3=O)C1Oc3cc(CCCCC)cc(O)c3C1C=C(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 520.622
CB1 binding score: -14.016
InChIKey:HUUPSGQSBUBXGQ-UHFFFAOYSA-N
ID: 125818
SMILES:C(=C(CCC=C(C)C)C)Cc1c(O)cc2c(c1)OC(C)(C)C1C2CC(C=O)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.555
CB1 binding score: -15.809
InChIKey:HQBCTDDZBQYYOV-UHFFFAOYSA-N
ID: 125819
SMILES:O1C2(C)CCC(Br)C(C)(C)Oc3cc(CCCCC)cc(O)c3C1C=C(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 465.472
CB1 binding score: -15.521
InChIKey:DRCJXGNXPNIONE-UHFFFAOYSA-N
ID: 125820
SMILES:N(C)CCc1cc(O)c(C2C(C(C)=C)CC=C(C)C2)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 285.431
CB1 binding score: -13.644
InChIKey:QUYKGARMYVSPDW-UHFFFAOYSA-N
ID: 125821
SMILES:O1C(OC)C2(C(=O)OC)C(CC1(C)C)C21Oc2cc(OC)cc(C)c2C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.422
CB1 binding score: -13.187
InChIKey:WPPGTTBIYRSOFD-UHFFFAOYSA-N
ID: 125822
SMILES:C1(Cc2c(O)cc(CCCCO)cc2OC)(C)OCCC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 294.391
CB1 binding score: -15.706
InChIKey:UCLPZZFJLHGGMD-UHFFFAOYSA-N
ID: 125823
SMILES:C(=C(C)C)CCc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -19.67
InChIKey:QXOBJECFIJLBPW-UHFFFAOYSA-N
ID: 125824
SMILES:CC(C)(c1cc(O)c2c(c1)OC1C2C(COC(=O)C)C2C(C1)C(C)(C)O2)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -16.829
InChIKey:DLQZTXNDHCNMNX-UHFFFAOYSA-N
ID: 125825
SMILES:c12c(O)cc(CCCCC)cc1OC(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: 125826
SMILES:C12c3c(OC)cc(CCCCC)cc3OC3(CC4(C5(C)C(C(C)(OO)C(OC(=O)C)CC5)CCC4C)C1(O)C3=O)OC2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 600.705
CB1 binding score: -14.618
InChIKey:QHWWRNTZJWIWJD-UHFFFAOYSA-N
ID: 125827
SMILES:C1(C)(C)C2CC(OC)C(C)=CC2c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.888
InChIKey:PUAYZKBVSPXFKX-UHFFFAOYSA-N
ID: 125828
SMILES:C(C)(C1CCC(C)=C1c1c(O)cc(CCC)cc1O)C=CC(C)=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -15.586
InChIKey:JXYWEODFJXLBHG-UHFFFAOYSA-N
ID: 125829
SMILES:C1(O)CC(C(C)=C)C(c2c(CCCCC)cc(O)cc2OC)C2C1(C)OOC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.574
CB1 binding score: -15.293
InChIKey:ABRXAWYUFAENJR-UHFFFAOYSA-N
ID: 125830
SMILES:C(CC=C(C)C)C(C)=CCc1c(O)cc(CCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -19.824
InChIKey:YJYIDZLGVYOPGU-UHFFFAOYSA-N
ID: 125831
SMILES:c1c(CCCN)c(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 301.43
CB1 binding score: -16.714
InChIKey:QUGRCEWGEVMVDG-UHFFFAOYSA-N
ID: 125832
SMILES:CC1(C)OC(=O)C2(C(CO)=C)Oc3c(c(OC)c(CCCCC)cc3OC2(C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.53
CB1 binding score: -15.418
InChIKey:ZTDARDLBYQGJGT-UHFFFAOYSA-N