ID: 52648
SMILES:C1(C)=CC2c3c(O)cc(C)cc3OC(CC=C(C)C)C2OC1CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.544
CB1 binding score: -15.567
InChIKey:GLAKLWQZZMSNHO-UHFFFAOYSA-N
ID: 52649
SMILES:C(CCCC)c1cc2c(c(O)c1)C1CC(C)(O2)CCC1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.198
InChIKey:NUXUDGMVYZUFNQ-UHFFFAOYSA-N
ID: 52650
SMILES:C12C(C)(C)C=CCC1(C)Oc1cc(CCCCC)cc(C)c1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.497
CB1 binding score: -15.038
InChIKey:RWZQFUADJZYDMW-UHFFFAOYSA-N
ID: 52651
SMILES:C1(C)Oc2c(c(O)cc(CCCCC)c2)C2C1C(O)OC=C2C(OC)=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.422
CB1 binding score: -15.329
InChIKey:XDKPZDMYUDMNBC-UHFFFAOYSA-N
ID: 52652
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -17.892
InChIKey:YCSIDAUWCFLSQK-UHFFFAOYSA-N
ID: 52653
SMILES:CCCCCc1cc(O)c2c(c1)OC(C)(C)C1C2[CH]C(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 313.461
CB1 binding score: -16.645
InChIKey:IDXZGOPCCVYPKD-UHFFFAOYSA-N
ID: 52654
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 52655
SMILES:Oc1cc2c(c(O)c1)C1C(C(C)(C)O2)C(O)C=C(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.332
CB1 binding score: -15.404
InChIKey:HLIXJFDGFMHHEB-UHFFFAOYSA-N
ID: 52656
SMILES:CC1(C(CC2CC=C(CCC=C(C)C)CC2)=O)C=C(c2c(O)ccc(O)c2)Oc2cc(O)cc(CCCCC)c21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 544.732
CB1 binding score: -14.019
InChIKey:LHHKDKRCHMTDCB-UHFFFAOYSA-N
ID: 52657
SMILES:[N+](C)(C)(CCCc1cc2c(c(C(C)C)c1OC(C)=O)OC(C)(C)C1CCC(C)=CC12)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.637
CB1 binding score: -13.203
InChIKey:BNLYGLZCSCPDKK-UHFFFAOYSA-N
ID: 52658
SMILES:[N+](C)(C1CCC(C)=CC1c1ccc(CCCCC)cc1)C(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 313.529
CB1 binding score: -14.325
InChIKey:HPCXKXIMUQCPQP-UHFFFAOYSA-N
ID: 52659
SMILES:O=Cc1c(O)c2c(cc1CCC)OC(C)(C)C1C2CC(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -17.454
InChIKey:LZXGZWMJXKDXFS-UHFFFAOYSA-N
ID: 52660
SMILES:C(C)C(OCc1c(CCCCC)cc2c(c1O)C1C(CCC(CO)=C1)C(C)(C)O2)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.558
CB1 binding score: -17.606
InChIKey:KDRXESPLTRKPNK-UHFFFAOYSA-N
ID: 52661
SMILES:C1(C)=CC2C(CC1)C(C)(C)Oc1cc(CCCCC)c(C(=O)OC)c(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -18.882
InChIKey:PZGQMCZVNQZFFP-UHFFFAOYSA-N
ID: 52662
SMILES:C1(=C)C(=O)OC2C3C(C)(C1)Oc1c(c(O)cc(CCCCC)c1)C3C=C2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.473
CB1 binding score: -14.91
InChIKey:AMOUSHORMFBALG-UHFFFAOYSA-N
ID: 52663
SMILES:Oc1c(C(=O)C(CC)C)c(O)c2c(c1C=O)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Phloroglucinols
Class: Cannabinoids;Phloroglucinol-terpene hybrids
MW: 372.461
CB1 binding score: -17.19
InChIKey:PCQGORPGJVHXJE-UHFFFAOYSA-N
ID: 52664
SMILES:c12c(cc(CCCCC)c(CC3C=C(C)CCC3C(C)=C)c1O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 462.718
CB1 binding score: -14.304
InChIKey:WAVWQECFSKVFQK-UHFFFAOYSA-N
ID: 52665
SMILES:c12oc3c(c(=O)c4c(o3)c(O)c3c(c3c1O)OC(C)(C)C1CCC(C)=CC41)CC(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.476
CB1 binding score: -14.801
InChIKey:VEBVBFAUBAQMOG-UHFFFAOYSA-N
ID: 52666
SMILES:C1(C)(O)CC2C(C(C)(C)Oc3cc(CCCCC)cc(O)c32)CC1Br
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 411.38
CB1 binding score: -17.717
InChIKey:RZAQCOHDJGOJRM-UHFFFAOYSA-N
ID: 52667
SMILES:c1c(O)cc(O)c2c1OC(C)(C)C1C2C(C(C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.376
CB1 binding score: -17.343
InChIKey:GHKMXNJVKJTYHY-UHFFFAOYSA-N
ID: 52668
SMILES:C12(C)C3(C)C(O)(CC1)C(C)CC2Oc1c3c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.226
InChIKey:BLPMZMZLMNZZTL-UHFFFAOYSA-N