ID: 116341
SMILES:C(OC1CC2(C)Oc3cc(C)c(O)cc3C(OCC)C2C(C)(C)O1)(=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.438
CB1 binding score: -15.98
InChIKey:IILNVBYQWZLNLM-UHFFFAOYSA-N
ID: 116342
SMILES:OC1C(C)(C)Oc2cc(CCCCC)cc(O)c2C1=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 278.348
CB1 binding score: -18.149
InChIKey:PWNRYJVNGXSCQW-UHFFFAOYSA-N
ID: 116343
SMILES:C1(C)(C)OC2=C(CC1)C(c1ccccc1)CC(COC(=O)C)C2C=CC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.555
CB1 binding score: -15.165
InChIKey:RCNHEHJSJFNOOP-UHFFFAOYSA-N
ID: 116344
SMILES:C1(C)(C)CCCC(=C)C1CCC(=O)c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -13.291
InChIKey:NNOWGPNBDKYVFY-UHFFFAOYSA-N
ID: 116345
SMILES:CC(=CCc1c(O)cc(CCCCC)cc1O)CCCC(CCC=C(C)C)(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.619
CB1 binding score: -18.634
InChIKey:SNYYKBLDQCTDDG-UHFFFAOYSA-N
ID: 116346
SMILES:C1C2C(CC1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -18.935
InChIKey:MJXUOMRQWPNCBO-UHFFFAOYSA-N
ID: 116347
SMILES:CCCc1c(O)c2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -17.792
InChIKey:XQGMRYMWQOMODG-UHFFFAOYSA-N
ID: 116348
SMILES:C12C(C)(C)Oc3c(c(O)cc(C(=O)O)c3C)C1C=C(C)CCC=C(C)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -14.724
InChIKey:XOSCYOMTJCQEIX-UHFFFAOYSA-N
ID: 116349
SMILES:O=C1C2(C(=O)C3=C1OC(C)C3)CC(C(O)(C)C)Oc1c2ccc(CCCCC)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.499
CB1 binding score: -12.993
InChIKey:JBPVNVBMAXCGMO-UHFFFAOYSA-N
ID: 116350
SMILES:C(C1C(=C)C(C)CC=C1C)C1C(=O)c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.49
CB1 binding score: -15.787
InChIKey:FISGYOABCPIQQW-UHFFFAOYSA-N
ID: 116351
SMILES:c1(CCCCC)cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CCC=C(C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -17.813
InChIKey:LISQMXYEJUYUCR-UHFFFAOYSA-N
ID: 116352
SMILES:C(O)(CCC(C)=CCc1c(O)cc(C)cc1Oc1cc(CCCCC)cc(O)c1)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Diphenyl ethers (DPEs)
Class: Cannabinoids;Fungal DPEs
MW: 426.597
CB1 binding score: -15.633
InChIKey:IVCYWXKTMZCPSX-UHFFFAOYSA-N
ID: 116353
SMILES:C(C)CCc1cc(O)c(C2(C)CCC(CO)=C2C)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -14.169
InChIKey:UWSJHUSRXVAFIQ-UHFFFAOYSA-N
ID: 116354
SMILES:C=C(C)C1C(c2c(O)cc(CCC)cc2O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.532
InChIKey:REOZWEGFPHTFEI-UHFFFAOYSA-N
ID: 116355
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1C2C(O)(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -18.762
InChIKey:ICMJYQRNULRNTK-UHFFFAOYSA-N
ID: 116356
SMILES:C(CCC)Cc1cc(O)cc(CC=C(C)C)c1O
Pathway: Polyketides
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Catechols with side chains
MW: 248.366
CB1 binding score: -17.913
InChIKey:OZBDRWFBMCCJHI-UHFFFAOYSA-N
ID: 116357
SMILES:c1(OC)cc(OC)c(C2C(C(=C)C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -18.651
InChIKey:RBOIQFDUPWFAHT-UHFFFAOYSA-N
ID: 116358
SMILES:C12C(CCC1C)C(C)(C)Oc1c2c(O)cc(CO)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.349
CB1 binding score: -17.796
InChIKey:XAGPVCMEKIDKRZ-UHFFFAOYSA-N
ID: 116359
SMILES:Oc1ccc(-c2c(CCC)cccc2)c(O)c1C1C=C(C)CCC1C(=C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.513
CB1 binding score: -15.987
InChIKey:FAIYZMODEPEBMF-UHFFFAOYSA-N
ID: 116360
SMILES:c1(O)c(CC=C(C)CCC=C(C)C)c(O)cc(CCCCC)c1C(=O)OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 374.521
CB1 binding score: -19.567
InChIKey:RSOBBJCWWQRAAM-UHFFFAOYSA-N
ID: 116361
SMILES:CC1=CC(c2c(O)cc(CCCCC)cc2O)C(C(C)=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N