ID: 58213
SMILES:CCC(=O)c1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -17.19
InChIKey:SEIHJYDQJGVOIG-UHFFFAOYSA-N
ID: 58214
SMILES:C1(Br)C2(C)C3C(c4c(cc(CCCCC)cc4O)OC3(C)CC2)OC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 409.364
CB1 binding score: -15.377
InChIKey:QSIHTYCHTRTKHZ-UHFFFAOYSA-N
ID: 58215
SMILES:c1(O)cc(O)c2c([n+]1C)OC(CCC=C(C)C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.475
CB1 binding score: -14.777
InChIKey:MKDFZGOVHBFPOL-UHFFFAOYSA-O
ID: 58216
SMILES:C1(C)(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: 58217
SMILES:C12(C)Oc3c(c(O)cc(CCCCCC)c3)C3OC(C)(C)C3CCC(C)(CCC1)C2C(O)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.639
CB1 binding score: -14.804
InChIKey:RIJWPNLMDIEEKG-UHFFFAOYSA-N
ID: 58218
SMILES:CCC(C)CC(c1c(O)c2c(cc1[CH])OC(C)(C)C1C2C=C(C(=O)OC)CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.543
CB1 binding score: -14.803
InChIKey:JWHZAMVWDPRBRX-UHFFFAOYSA-N
ID: 58219
SMILES:CC1(C)C(c2c(O)cc(CCCCC)cc2O)CC(C)=CCC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -18.27
InChIKey:JNUWKSNIBRJTBP-UHFFFAOYSA-N
ID: 58220
SMILES:c1c(O)c2c(cc1)OC(C)(C)C1CCC(C)C12C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.35
CB1 binding score: -16.502
InChIKey:GYBPZBYFTPUHCX-UHFFFAOYSA-N
ID: 58221
SMILES:C1(C)=CC(c2c(OC)cc(CCCC)cc2O)C(C(C)=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.499
InChIKey:CDCJUBPCFJBDNF-UHFFFAOYSA-N
ID: 58222
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1=CCC(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.797
InChIKey:UQOUHXDCXBITSF-UHFFFAOYSA-N
ID: 58223
SMILES:C(CC)(CCCc1cc2c(cc1O)OC(C)(C)C1C2C=C(C)CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -11.814
InChIKey:TXWANCXSXXFIHT-UHFFFAOYSA-N
ID: 58224
SMILES:C1C(O)C(C)=CC2c3c(cc(C)c(Br)c3O)OC(C)(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 353.256
CB1 binding score: -17.128
InChIKey:BIPYBLWOEKAXKP-UHFFFAOYSA-N
ID: 58225
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 58226
SMILES:C1C(C)CCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -20.541
InChIKey:XKRHRBJLCLXSGE-UHFFFAOYSA-N
ID: 58227
SMILES:C(=CCCC1(C)Oc2c(c(OC)cc(CCCCC)c2)C(=O)C1)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -17.182
InChIKey:ZVABNYCTMQAGTJ-UHFFFAOYSA-N
ID: 58228
SMILES:c1(CCC)cc(O)c2c(c1)OC(CCC1C(C)(O)CCC(=O)C1(C)C)(C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -15.358
InChIKey:DZGAKKATVATMEV-UHFFFAOYSA-N
ID: 58229
SMILES:C12CC(=O)C(C)CC1C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.547
InChIKey:JGSKJCUYQGMACF-UHFFFAOYSA-N
ID: 58230
SMILES:CNCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 287.403
CB1 binding score: -16.51
InChIKey:MRVJHMXGZJAJAR-UHFFFAOYSA-N
ID: 58231
SMILES:C1=C(C)CCC(C(=C)C)C1c1c(O)cc(C)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.979
InChIKey:GKVOVXWEBSQJPA-UHFFFAOYSA-N
ID: 58232
SMILES:C1(=O)C(=O)C2=C(OC(C)(C)C3CCC(C)=CC32)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.306
CB1 binding score: -16.694
InChIKey:MYPXZCYBCLRBFD-UHFFFAOYSA-N
ID: 58233
SMILES:CC(=CCCC(=CCc1c(O)cc(CCCCC)c(C(=O)O)c1O)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N