ID: 142003
SMILES:CC1(C)Oc2cc(CCCCC)cc(OC)c2C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.377
CB1 binding score: -18.771
InChIKey:NUDQDNWIMDAJAE-UHFFFAOYSA-N
ID: 142004
SMILES:CCc1c(O)c2c(c(O)c1)C1C(CCC(C)=C2)C(C)(C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -14.946
InChIKey:GBWQQVXSHGFAJR-UHFFFAOYSA-N
ID: 142005
SMILES:C1C2C(C(C)(C)Oc3c2c(O)cc(CCCCC)c3)C(C=C(C)C)=C(CO)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -15.554
InChIKey:JBBWMLSGUZCVEH-UHFFFAOYSA-N
ID: 142006
SMILES:O(CC(=CCC1(C)C2CCC(C)=CC2c2c(O)cc(CCCCC)cc2O1)C)Cc1ccccc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 474.685
CB1 binding score: -15.744
InChIKey:UTMXCVNRFNFPQW-UHFFFAOYSA-N
ID: 142007
SMILES:c12c(cc(CCCC)cc1O)C1=C(CC2C(C)C)C(C)(C)C(c2cc(O)cc(C(=O)OC)c2)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 476.657
CB1 binding score: -15.801
InChIKey:DTHDOTFJHKOAIH-UHFFFAOYSA-N
ID: 142008
SMILES:CC1=CCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.186
InChIKey:KQQMZTULVOWZJR-UHFFFAOYSA-N
ID: 142009
SMILES:c1(CCO)cc2c(c(O)c1)C1C(C(=C)C)CCC(C)(O2)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -15.824
InChIKey:VCOSOWYZEIULGE-UHFFFAOYSA-N
ID: 142010
SMILES:C(=C(C)C)CCC(C)=CCc1c(OC)cc2c(c1)OC(C)(C)C1CCC(CO)=CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.598
CB1 binding score: -11.493
InChIKey:KKNUYBBRBYIYAS-UHFFFAOYSA-N
ID: 142011
SMILES:C(CCC1=CCOC1=O)c1cc2c(c(O)c1)C1C(CC(O)C(C)(C)O1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.487
CB1 binding score: -15.554
InChIKey:WUEGCWLLSLMGDF-UHFFFAOYSA-N
ID: 142012
SMILES:c1c(OC)cc(Cc2cc(O)c3c(c2)OC(C)(C)C2CCC(C)=CC32)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.484
CB1 binding score: -15.588
InChIKey:VAUXISLDNMCYKA-UHFFFAOYSA-N
ID: 142013
SMILES:c1(C(C)C)cc(O)c2c(c1)OC(C)(C)C1CC=C(CO)CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -17.291
InChIKey:IOHAMMCHDLCRHI-UHFFFAOYSA-N
ID: 142014
SMILES:O[n+]1c(C)c2c(c(O)c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.356
CB1 binding score: -15.395
InChIKey:GHXFNWKMUWLHNQ-UHFFFAOYSA-O
ID: 142015
SMILES:C12C(C(C)(C)Oc3cc(C)ccc31)CCC(C)=CCCC2(C)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.943
InChIKey:KSBCWQLGBMYAQS-UHFFFAOYSA-N
ID: 142016
SMILES:C(C)OC(c1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -16.087
InChIKey:FJSHBIUGPPFRMX-UHFFFAOYSA-N
ID: 142017
SMILES:C1=C(C)CCC12c1c(cc(CCCCC)cc1OC)OC(=O)C2=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.408
CB1 binding score: -15.267
InChIKey:JRXZYXKZZMLUPR-UHFFFAOYSA-N
ID: 142018
SMILES:CCCCCc1cc(O)c2c(c1)OC(C)(C)C1CCC(=C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -16.997
InChIKey:ISNNJUKWOZFMJI-UHFFFAOYSA-N
ID: 142019
SMILES:C(c1c(OC)c2c(c(OC)c1)OC(C)(C)C1C2CC(C)=CC1)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -13.478
InChIKey:XWSDQUMVWHUDFM-UHFFFAOYSA-N
ID: 142020
SMILES:C1CC(C)=CC(O)C2C(c3c(O)cc(CCCCC)cc3O2)C1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.187
InChIKey:GDLHJSIIDYJAQX-UHFFFAOYSA-N
ID: 142021
SMILES:C1C(C)=CC2C(C(C)(C)Oc3cc(CCCCC)cc(O)c32)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 142022
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1CC(O)C(O)(C)CC12)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.456
CB1 binding score: -16.563
InChIKey:SNPHSPHUPGUCAY-UHFFFAOYSA-N
ID: 142023
SMILES:C(COc1cc(CCCCC)cc(O)c1)(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.474
CB1 binding score: -15.626
InChIKey:ZFCQHOICMXHQGI-UHFFFAOYSA-N