ID: 114535
SMILES:O1c2c(c(O)cc(CCCCC)c2)CC[N+](C)(C)C1c1cc(OC)c(O)cc1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.512
CB1 binding score: Not available
InChIKey:NTUHYDIWLUIZNV-UHFFFAOYSA-O
ID: 114536
SMILES:C(CCCC)c1ccc2c(c1)OC(C)(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 218.34
CB1 binding score: -18.809
InChIKey:SITXGCKRIIIRNU-UHFFFAOYSA-N
ID: 114537
SMILES:O(c1c(OC)c2c(c(O)c1CCCCC)C1C(C(C)(C)O2)CCC1(C)O)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 378.509
CB1 binding score: -14.416
InChIKey:TZHZKFNVFRZUML-UHFFFAOYSA-N
ID: 114538
SMILES:Oc1c(C2C(C(C)C)CCC3(C)CCCC(C)=C32)c(O)cc(CCC)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -13.678
InChIKey:MJWDDCSEXYDGON-UHFFFAOYSA-N
ID: 114539
SMILES:CC(C)CC(OCc1cc(OC)c(C2C=C(C)CCC2C(C)=C)c(O)c1)CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.657
CB1 binding score: -15.047
InChIKey:KBCYJSYXUQGWJS-UHFFFAOYSA-N
ID: 114540
SMILES:c1c(O)c(C2C(C(C)(C)O)CC3C4(C)OC4CC3(C)C(C)=C2)c(O)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -16.055
InChIKey:KRAMRKORZDJHJY-UHFFFAOYSA-N
ID: 114541
SMILES:C(C)(C1CCC(C)CC1c1c(O)cc(CCCCC)cc1OC)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.528
CB1 binding score: -18.883
InChIKey:KKBNGEMFBFEYQN-UHFFFAOYSA-N
ID: 114542
SMILES:O1c2cc(CCCCC)cc(O)c2C2C1(O)C(O)=C1C(=C(C)C2=O)CCC(C)(CCC=C(C)C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 482.617
CB1 binding score: -13.633
InChIKey:UGMYPUXSABIIMM-UHFFFAOYSA-N
ID: 114543
SMILES:C1(C)=CC(c2c(O)cc(CCC)cc2O)C(C(C)=C)CC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -17.108
InChIKey:PPZWAHLWZVOCDJ-UHFFFAOYSA-N
ID: 114544
SMILES:CCCCCc1ccc(OC)c2c1OC(C)(C)C1C(C(C(=O)OC)C(=O)OC)CC1C2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 460.611
CB1 binding score: -13.711
InChIKey:BMJDTSPJFNCZNC-UHFFFAOYSA-N
ID: 114545
SMILES:C(O)CCc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -17.758
InChIKey:TXVRIJHVLPFPMD-UHFFFAOYSA-N
ID: 114546
SMILES:c1(O)c2c(c(OC)cc1CCCC)OC(C)(CCC=C(C)C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -13.366
InChIKey:DLASUWFJMODKPC-UHFFFAOYSA-N
ID: 114547
SMILES:C12c3c(O)cc(CCCCC)cc3OC(C)(C)C1CCC(=C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.055
InChIKey:AOYYFUGUUIRBML-UHFFFAOYSA-N
ID: 114548
SMILES:CC1=CC2c3c(cccc3)OC(C)(C)C2CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 228.335
CB1 binding score: -18.438
InChIKey:CBEWCUWSPDDHMI-UHFFFAOYSA-N
ID: 114549
SMILES:c1(C)c(O)c(C(CSCC(O)C(=O)O)=O)c2c(c1O)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 436.526
CB1 binding score: -14.826
InChIKey:BHCSULVCXGIUJG-UHFFFAOYSA-N
ID: 114550
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(CCC=C(C)C)C=C2)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -18.868
InChIKey:CJHDLPIPPSHNLG-UHFFFAOYSA-N
ID: 114551
SMILES:c12c3c(cc(CCCCC)c1)OC(C(C)(C)O2)CC1C(C)(O)CCC1C(C)(O)C3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.575
CB1 binding score: -14.605
InChIKey:QFZMOJFNHPFNEH-UHFFFAOYSA-N
ID: 114552
SMILES:C1(C)=CC(c2c(O)cc(O)cc2C)C(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.798
InChIKey:KDZOUSULXZNDJH-UHFFFAOYSA-N
ID: 114553
SMILES:C(CC(=O)C=C(C)C)(C)=CCc1c(O)cc(CCCCCO)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 346.467
CB1 binding score: -13.687
InChIKey:LNLQLVCPCUJHKZ-UHFFFAOYSA-N
ID: 114554
SMILES:CC(C)c1cc2c(cc1O)C(O)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -12.087
InChIKey:IHZOHHRNQGAPSE-UHFFFAOYSA-N
ID: 114555
SMILES:C1(C)=CC(c2c(OC)c(OC)cc(CCCC(O)=O)c2)C(C(C)(C)O)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -10.774
InChIKey:OPULQNYYMQXYKF-UHFFFAOYSA-N